- InChI
- InChI=1S/C12H22O4/c1-5-15-10(13)7-6-8-11(14)16-9-12(2,3)4/h5-9H2,1-4H3
- InChI Key
- BIBNLWLYFRCTPS-UHFFFAOYSA-N
- Formula
- C12H22O4
- SMILES
- CCOC(=O)CCCC(=O)OCC(C)(C)C
- Molecular Weight1
- 230.30
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -414.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -789.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.32 | kJ/mol | Joback Calculated Property |
| log10WS | -2.33 | Crippen Calculated Property | |
| logPoct/wat | 2.309 | Crippen Calculated Property | |
| McVol | 194.820 | ml/mol | McGowan Calculated Property |
| Pc | 1959.60 | kPa | Joback Calculated Property |
| Inp | [1490.00; 1490.00] |
|
|
| Inp | 1490.00 | NIST | |
| Inp | 1490.00 | NIST | |
| Tboil | 623.31 | K | Joback Calculated Property |
| Tc | 809.02 | K | Joback Calculated Property |
| Tfus | 371.74 | K | Joback Calculated Property |
| Vc | 0.745 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [518.96; 598.65] | J/mol×K | [623.31; 809.02] |
|
| Cp,gas | 518.96 | J/mol×K | 623.31 | Joback Calculated Property |
| Cp,gas | 534.07 | J/mol×K | 654.26 | Joback Calculated Property |
| Cp,gas | 548.44 | J/mol×K | 685.21 | Joback Calculated Property |
| Cp,gas | 562.07 | J/mol×K | 716.16 | Joback Calculated Property |
| Cp,gas | 574.97 | J/mol×K | 747.12 | Joback Calculated Property |
| Cp,gas | 587.16 | J/mol×K | 778.07 | Joback Calculated Property |
| Cp,gas | 598.65 | J/mol×K | 809.02 | Joback Calculated Property |
| η | [0.0001337; 0.0018446] | Pa×s | [371.74; 623.31] |
|
| η | 0.0018446 | Pa×s | 371.74 | Joback Calculated Property |
| η | 0.0009542 | Pa×s | 413.67 | Joback Calculated Property |
| η | 0.0005573 | Pa×s | 455.60 | Joback Calculated Property |
| η | 0.0003563 | Pa×s | 497.52 | Joback Calculated Property |
| η | 0.0002443 | Pa×s | 539.45 | Joback Calculated Property |
| η | 0.0001768 | Pa×s | 581.38 | Joback Calculated Property |
| η | 0.0001337 | Pa×s | 623.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, ethyl neopentyl ester.
Sources
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